N-[(Z)-[(4-fluorophenyl)-(4-piperidin-1-ylphenyl)methylidene]amino]aniline
Formula:C24H24N3F
Mutagenic:high
Tumorigenic:high
Reproductive Effective:none
N-[(Z)-[(4-fluorophenyl)-(4-piperidin-1-ylphenyl)methylidene]amino]aniline is not a drug-like molecule.
| MolName | N-[(Z)-[(4-fluorophenyl)-(4-piperidin-1-ylphenyl)methylidene]amino]aniline |
| MolecularFormula | C24H24N3F |
| Smiles | Fc(cc1)ccc1/C(/c(cc1)ccc1N1CCCCC1)=N\Nc1ccccc1 |
| InChI | InChI=1S/C24H24FN3/c25-21-13-9-19(10-14-21)24(27-26-22-7-3-1-4-8-22)20-11-15-23(16-12-20)28-17-5-2-6-18-28/h1,3-4,7-16,26H,2,5-6,17-18H2 |
| InChIK | XUJTXRSPIXTQFV-UHFFFAOYSA-N |
| TotalMolweight | 373.474 |
| Molweight | 373.474 |
| MonoisotopicMass | 373.195425 |
| CLogP | 6.9714 |
| CLogS | -6.231 |
| H Acceptors | 3 |
| H Donors | 1 |
| TotalSurfaceArea | 299.16 |
| Relative PSA | 0.088648 |
| PolarSurfaceArea | 27.63 |
| Druglikeness | 0.74425 |
| Mutagenic | high |
| Tumorigenic | high |
| Reproductive Effective | none |
| Irritant | none |
| Nasty Functions | |
| Shape Index | 0.53571 |
| Fragments | 1 |
| Non HAtoms | 28 |
| NonCHAtoms | 4 |
| Electronegative Atoms | 4 |
| Rotatable Bond | 5 |
| Rings Closures | 4 |
| Small Rings | 4 |
| Aromatic Rings | 3 |
| Aromatic Atoms | 18 |
| Sp3Atoms | 5 |
| Symmetricatoms | 8 |
| Amines | 1 |
| Aromatic Amines | 1 |
| StereoCon |
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